Glycoside
GD004107
Name:
NoneFormula:
C53H90O10NSmiles:
CCCCCCCCCCCC[N+](C)(C)[C@@H]1CC[C@H](O[C@@H]2CCC[C@H](CC)OC(=O)C[C@@H]3C(=C[C@H]4[C@H]5C[C@@H](O[C@@H]6O[C@H](C)[C@H](OC)[C@H](OC)[C@H]6OC)C[C@H]5C=C[C@@H]34)C(=O)[C@H]2C)O[C@H]1CAglycone:
CCCCCCCCCCCC[N+](C)(C)C1CCC(OC2CCCC(CC)OC(=O)CC3C(=CC4C3C=CC3CC(O)CC34)C(=O)C2C)OC1CSugarmoiety:
COC1C(C)OC(O)C(OC)C1OCOther Identifiers
Properties
| HBA: | 11 | RingCount: | 6 |
| HBD: | 0 | FractionCSP3: | 0.89 |
| AlogP: | 9.92 | Num_rotatable_bonds: | 20 |
| MolWt: | 901.3 | Num_heavy_atoms: | 64 |
| TPSA: | 107.98 | NumAromaticRings: | 0 |
Unique Aglycone
AD03638
Formula: C44H74O6N
Smiles:
CCCCCCCCCCCC[N+](C)(C)C1CCC(OC2CCCC(CC)OC(=O)CC3C(=CC4C3C=CC3CC(O)CC34)C(=O)C2C)OC1C| HBA: | 7 | RingCount: | 5 |
| HBD: | 1 | FractionCSP3: | 0.86 |
| AlogP: | 9.11 | Num_rotatable_bonds: | 15 |
| MolWt: | 713.08 | Num_heavy_atoms: | 51 |
| TPSA: | 82.06 | NumAromaticRings: | 0 |
